%chk=000088590.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088590

0 1
 O    1.639700      -1.474500     -0.2375000    
 O   -1.700200      0.4496000      -1.758100    
 O  -0.8960000      -3.008000     -3.7599999E-02
 O    3.758800      -1.359200      0.5970000    
 C  -0.6033000     -0.5750000      0.1701000    
 C   0.6324000     -0.5820000     -0.7558000    
 C   -1.722900      0.3984000     -0.3126000    
 C    1.377100      0.7232000      -1.060000    
 C   -1.633100       1.861700      0.1841000    
 C   0.6499000       2.077100      -1.072400    
 C  -0.2084000       2.460800      0.1318000    
 C    2.705200      0.6308000     -0.2981000    
 C   -1.381300      -1.890200      5.5500001E-02
 C  -0.2509000     -0.5206000       1.670200    
 C   -2.995100     -0.3473000     -7.9999998E-04
 C    2.791100     -0.8225000      7.6800004E-02
 C   -2.834000      -1.662800      0.1568000    
 C   -2.243900       2.133400       1.566300    
 C    2.915000       1.507100      0.9243000    
 H   0.3377000      -1.028300      -1.715300    
 H    1.687900      0.6052000      -2.112900    
 H   -2.229100       2.461200     -0.5217000    
 H   3.9500002E-02   2.151900      -1.980600    
 H    1.412900       2.857100      -1.199600    
 H   0.3293000       2.266300       1.060600    
 H  -0.3266000       3.553800      0.1105000    
 H    3.518500      0.8330000      -1.007500    
 H   -1.143700     -0.5807000       2.303400    
 H   0.3775000      -1.370300       1.963900    
 H   0.2856000      0.3830000       1.946900    
 H   -3.970000      0.1223000     -1.7600000E-02
 H   -3.583600      -2.418400      0.3083000    
 H   -2.217000       3.207300       1.785100    
 H   -3.293600       1.828300       1.610500    
 H   -1.705900       1.628900       2.371100    
 H   -1.821400     -0.4458000      -2.117000    
 H    3.934000       1.377100       1.307700    
 H    2.794000       2.568000      0.6889000    
 H    2.246100       1.245200       1.746100    


%chk=000088590-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000088590

0 1
O 1.670163 -1.523968 -0.226376
O -1.712329 0.523070 -1.797776
O -0.909330 -3.141452 -0.010501
O 3.819438 -1.404167 0.623642
C -0.611414 -0.627426 0.164357
C 0.623021 -0.608857 -0.785899
C -1.720005 0.398998 -0.288745
C 1.396919 0.730381 -1.107494
C -1.636324 1.875129 0.185694
C 0.650521 2.092398 -1.109514
C -0.205701 2.483474 0.119620
C 2.724945 0.653037 -0.281041
C -1.398574 -1.990251 0.085215
C -0.214106 -0.530984 1.665451
C -3.032248 -0.319065 0.022875
C 2.853526 -0.830107 0.093028
C -2.853378 -1.661833 0.179593
C -2.259204 2.140322 1.578667
C 2.921270 1.533376 0.979457
H 0.321254 -1.083555 -1.733988
H 1.717841 0.590630 -2.159742
H -2.258169 2.412598 -0.559851
H 0.006153 2.129363 -2.004969
H 1.429105 2.869547 -1.250679
H 0.337838 2.258010 1.053446
H -0.331708 3.584802 0.113723
H 3.573083 0.884396 -0.953208
H -1.102335 -0.593449 2.316972
H 0.450746 -1.375838 1.909758
H 0.315773 0.405057 1.897739
H -3.989949 0.209724 -0.012471
H -3.620917 -2.430022 0.300503
H -2.260463 3.228165 1.776277
H -3.306172 1.794198 1.647212
H -1.688880 1.658399 2.390356
H -1.994501 -0.346983 -2.185244
H 3.937068 1.362906 1.377092
H 2.820542 2.604461 0.731963
H 2.208702 1.290617 1.785659


